CS-0531662
(Z)-3-(4-Chlorobenzylidene)isobenzofuran-1(3H)-one Azelastine Impurity
Manufacturer: ChemScene
CAS Number: 105279-16-1
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Purity
98%
MDL No
MFCD23115631
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₅H₉ClO₂
Molecular Weight
256.68
Synonyms
(Z)-3-(4-chlorobenzylidene)isobenzofuran-1(3H)-one
SMILES
O=C(O/1)C2=CC=CC=C2C1=C\C3=CC=C(C=C3)Cl
Tpsa
26.3
Logp
4.0085
H Acceptors
2
H Donors
0
Rotatable Bonds
1
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: MFCD23115631
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₉ClO₂
Molecular Weight: 256.68
Synonyms: (Z)-3-(4-chlorobenzylidene)isobenzofuran-1(3H)-one
SMILES: O=C(O/1)C2=CC=CC=C2C1=C\C3=CC=C(C=C3)Cl
Tpsa: 26.3
Logp: 4.0085
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD23115631
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₉ClO₂
Molecular Weight:
256.68
Synonyms:
(Z)-3-(4-chlorobenzylidene)isobenzofuran-1(3H)-one
SMILES:
O=C(O/1)C2=CC=CC=C2C1=C\C3=CC=C(C=C3)Cl
Tpsa:
26.3
Logp:
4.0085
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₄ClN₃OS
Molecular Weight: 389.94
Synonyms: Prochlorperazine Sulfoxide
SMILES: O=S1C2=C(N(CCCN3CCN(CC3)C)C4=CC(Cl)=CC=C41)C=CC=C2
Tpsa: 26.79
Logp: 3.5957
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₄ClN₃OS
Molecular Weight:
389.94
Synonyms:
Prochlorperazine Sulfoxide
SMILES:
O=S1C2=C(N(CCCN3CCN(CC3)C)C4=CC(Cl)=CC=C41)C=CC=C2
Tpsa:
26.79
Logp:
3.5957
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₅H₃₃F₃O₅S
Molecular Weight: 502.59
Synonyms: 6alpha,9-Difluoro-17-(((fluoromethyl)sulfanyl)carbonyl)-11beta-hydroxy-16alpha-methyl-3-oxoandrost-4-en-17alpha-yl propanoate
SMILES: CCC(O[C@]1([C@@]2([C@@]([C@@]3([H])[C@]([C@H](C2)O)([C@@]4(C([C@H](C3)F)=CC(CC4)=O)C)F)([H])C[C@H]1C)C)C(SCF)=O)=O
Tpsa: 80.67
Logp: 4.654
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₃₃F₃O₅S
Molecular Weight:
502.59
Synonyms:
6alpha,9-Difluoro-17-(((fluoromethyl)sulfanyl)carbonyl)-11beta-hydroxy-16alpha-methyl-3-oxoandrost-4-en-17alpha-yl propanoate
SMILES:
CCC(O[C@]1([C@@]2([C@@]([C@@]3([H])[C@]([C@H](C2)O)([C@@]4(C([C@H](C3)F)=CC(CC4)=O)C)F)([H])C[C@H]1C)C)C(SCF)=O)=O
Tpsa:
80.67
Logp:
4.654
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₃H₃₀O₄
Molecular Weight: 370.48
Synonyms: Melengestro acetate
SMILES: CC(O[C@]1([C@@]2([C@@]([C@@]3([H])[C@]([C@@]4(C(C=C3)=CC(CC4)=O)C)([H])CC2)([H])CC1)C)C(C)=O)=O
Tpsa: 60.44
Logp: 4.1852
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₃₀O₄
Molecular Weight:
370.48
Synonyms:
Melengestro acetate
SMILES:
CC(O[C@]1([C@@]2([C@@]([C@@]3([H])[C@]([C@@]4(C(C=C3)=CC(CC4)=O)C)([H])CC2)([H])CC1)C)C(C)=O)=O
Tpsa:
60.44
Logp:
4.1852
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2